Glycoside
...
GD127742

Name:
6-{[3-(diaminomethyl)phenyl](hydroxy)methyl}-5-hydroxy-4-(hydroxymethyl)-9,10-dioxo-1-(2-phenylethenyl)-7-[(3,4,4,5-tetrahydroxy-6-methyloxan-2-yl)oxy]-9,10-dihydroanthracen-2-yl acetate

Formula:
C39H38O13N2

Smiles:
CC(=O)Oc1cc(CO)c2c(c1C=Cc1ccccc1)C(=O)c1cc(OC3OC(C)C(O)C(O)(O)C3O)c(C(O)c3cccc(C(N)N)c3)c(O)c1C2=O

Aglycone:
CC(=O)Oc1cc(CO)c2c(c1C=Cc1ccccc1)C(=O)c1cc(O)c(C(O)c3cccc(C(N)N)c3)c(O)c1C2=O

Sugarmoiety:
CC1OC(O)C(O)C(O)(O)C1O

Other Identifiers

Properties
HBA: 15 RingCount: 6
HBD: 11 FractionCSP3: 0.26
AlogP: 1.28 Num_rotatable_bonds: 9
MolWt: 742.73 Num_heavy_atoms: 54
TPSA: 272.55 NumAromaticRings: 4

Unique Aglycone
AD51742
Formula: C33H28O8N2

Smiles:
CC(=O)Oc1cc(CO)c2c(c1C=Cc1ccccc1)C(=O)c1cc(O)c(C(O)c3cccc(C(N)N)c3)c(O)c1C2=O
HBA: 10 RingCount: 5
HBD: 8 FractionCSP3: 0.12
AlogP: 3.46 Num_rotatable_bonds: 7
MolWt: 580.59 Num_heavy_atoms: 43
TPSA: 193.4 NumAromaticRings: 4

Sugarmoiety
SD04321

CC1OC(O)C(O)C(O)(O)C1O